ChemSpider 2D Image | 1,3,5,7-Adamantanetetracarboxylic acid | C14H16O8

1,3,5,7-Adamantanetetracarboxylic acid

  • Molecular FormulaC14H16O8
  • Average mass312.272 Da
  • Monoisotopic mass312.084503 Da
  • ChemSpider ID34997871

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,3,5,7-Adamantanetetracarboxylic acid [ACD/IUPAC Name]
1,3,5,7-Adamantantetracarbonsäure [German] [ACD/IUPAC Name]
1,3,5,7-Admantane tetracarboxylic acid
100884-80-8 [RN]
Acide 1,3,5,7-adamantanetétracarboxylique [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1,3,5,7-tetracarboxylic acid [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.9±0.1 g/cm3
Boiling Point: 403.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.9±6.0 kJ/mol
Flash Point: 212.0±23.8 °C
Index of Refraction: 1.722
Molar Refractivity: 66.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.49
ACD/LogD (pH 5.5): -4.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 149 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 140.1±3.0 dyne/cm
Molar Volume: 167.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement